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10H-Dibenzo[b,f][1,4]oxazepin-11-one, 3-benzylsulfanyl-1-nitro-
SpectraBase Compound ID 4SohRVAoAvc
InChI InChI=1S/C20H14N2O4S/c23-20-19-16(22(24)25)10-14(27-12-13-6-2-1-3-7-13)11-18(19)26-17-9-5-4-8-15(17)21-20/h1-11H,12H2,(H,21,23)
InChIKey WJKXPRPIIHNTMY-UHFFFAOYSA-N
Mol Weight 378.4 g/mol
Molecular Formula C20H14N2O4S
Exact Mass 378.067428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7627y1PROLx
Name 10H-Dibenzo[b,f][1,4]oxazepin-11-one, 3-benzylsulfanyl-1-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N2O4S
InChI InChI=1S/C20H14N2O4S/c23-20-19-16(22(24)25)10-14(27-12-13-6-2-1-3-7-13)11-18(19)26-17-9-5-4-8-15(17)21-20/h1-11H,12H2,(H,21,23)
InChIKey WJKXPRPIIHNTMY-UHFFFAOYSA-N
Molecular Weight 378.402 g/mol
SMILES N1c2ccccc2Oc2cc(cc(c2C1=O)N(=O)=O)SCc1ccccc1
SPLASH splash10-0006-9101000000-e4e7afb1d76e04e364f5
Synonyms 3-(benzylsulfanyl)-1-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one 7-Nitro-9-(phenylmethylsulfanyl)-5H-benzo[b][1,4]benzoxazepin-6-one 7-Nitro-9-(phenylmethylthio)-5H-benzo[b][1,4]benzoxazepin-6-one 9-(benzylthio)-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one 9-Benzylsulfanyl-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
Wiley ID 1441615